SCHEMBL5798495

SCHEMBL5798495

Cc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 2/20 0.48
MAPT P10636 4/20 0.48
TSHR P16473 1/20 0.47
POLB P06746 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5774095 0.81 KDM4E (0.56) ALDH1A1KDM4ESMN1; SMN2HTTMAPK1
SCHEMBL5746621 0.80 KMT2A (0.65) ALDH1A1KDM4ESMN1; SMN2MAPTMAPK1
SCHEMBL6349105 0.78 CNR2 (0.46) SMN1; SMN2MAPTPOLB
SCHEMBL5746517 0.78 L3MBTL1 (0.52) ALDH1A1SMN1; SMN2MAPTPOLBTP53
SCHEMBL6349294 0.77 MAPT (0.52) SMN1; SMN2MAPTPOLBTP53
SCHEMBL5745462 0.77 MAPT (0.59) ALDH1A1KDM4ESMN1; SMN2HTTMAPT
SCHEMBL5798425 0.77 THRB (0.56) ALDH1A1SMN1; SMN2HTTMAPTTP53
SCHEMBL5775668 0.76 MAPT (0.53) ALDH1A1KDM4ESMN1; SMN2MAPTTSHR
SCHEMBL5749721 0.76 MAPT (0.53) ALDH1A1SMN1; SMN2HTTMAPTPOLB
SCHEMBL5773090 0.75 HSD11B1 (0.53) SMN1; SMN2MAPTPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1735280-A1 ARYL SULFONAMIDE AND SULFONYL COMPOUNDS AS MODULATORS OF PPAR AND METHODS OF TREATING METABOLIC DISORDERS Kalypsys, Inc. (US) 2006-12-27 EP disclosed
WO-2005115983-A1 ARYL SULFONAMIDE AND SULFONYL COMPOUNDS AS MODULATORS OF PPAR AND METHODS OF TREATING METABOLIC DISORDERS KALYPSYS, INC. (US) 2005-12-08 WO disclosed
US-20050234046-A1 Aryl sulfonamide and sulfonyl compounds as modulators of PPAR and methods of treating metabolic disorders KALYPSYS, INC. (US) 2005-10-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050234046-A1 Aryl sulfonamide and sulfonyl compounds as modulators of PPAR and methods of treating metabolic disorders PPARA, PPARG, PPARD ALDH1A1 883/4885KDM4E 3692/4885SMN1; SMN2 2173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.